methyl 5-[(3-aminocarbonyl-4-fluoranyl-phenyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[(3-aminocarbonyl-4-fluoranyl-phenyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[(3-carbamoyl-4-fluoro-phenyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(3-carbamoyl-4-fluoroanilino)-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[(3-carbamoyl-4-fluorophenyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(3-carbamoyl-4-fluoro-phenyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C16H16FN3O4 MolecularWeight: 333.314343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)NC2=CC(=C(C=C2)F)C(=O)N

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)NC2=CC(=C(C=C2)F)C(=O)N

InChI

InChI=1S/C16H16FN3O4/c1-7-12(16(23)24-3)8(2)19-13(7)15(22)20-9-4-5-11(17)10(6-9)14(18)21/h4-6,19H,1-3H3,(H2,18,21)(H,20,22)